(2E)-4-azanyl-2-[2-(4-methylphenoxy)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-6-piperidin-3-yl-1H-pyrimidine-5-carbonitrile

Systemtic Name: (2E)-4-azanyl-2-[2-(4-methylphenoxy)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-6-piperidin-3-yl-1H-pyrimidine-5-carbonitrile Openeye Name: (2E)-4-amino-2-[2-(4-methylphenoxy)-6-oxo-cyclohexa-2,4-dien-1-ylidene]-6-(3-piperidyl)-1H-pyrimidine-5-carbonitrile CAS Name: (2E)-4-amino-2-[2-(4-methylphenoxy)-6-oxo-1-cyclohexa-2,4-dienylidene]-6-(3-piperidinyl)-1H-pyrimidine-5-carbonitrile IUPAC Name: (2E)-4-amino-2-[2-(4-methylphenoxy)-6-oxocyclohexa-2,4-dien-1-ylidene]-6-piperidin-3-yl-1H-pyrimidine-5-carbonitrile Traditional Name: (2E)-4-amino-2-[6-keto-2-(4-methylphenoxy)cyclohexa-2,4-dien-1-ylidene]-6-(3-piperidyl)-1H-pyrimidine-5-carbonitrile Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=CC(=O)C2=C3NC(=C(C(=N3)N)C#N)C4CCCNC4

Isomeric SMILES

CC1=CC=C(C=C1)OC\2=CC=CC(=O)/C2=C/3\NC(=C(C(=N3)N)C#N)C4CCCNC4

InChI

InChI=1S/C23H23N5O2/c1-14-7-9-16(10-8-14)30-19-6-2-5-18(29)20(19)23-27-21(15-4-3-11-26-13-15)17(12-24)22(25)28-23/h2,5-10,15,26-27H,3-4,11,13H2,1H3,(H2,25,28)/b23-20-